# Summary of NMR spectra (SCF GIAO Magnetic shielding)
# Values for element C only
# Reference:  TMS mPW1PW91/aug-cc-pvdz BENZENE GIAO
# Reference shielding:  193.772 ppm
# Degenerate peaks are condensed together (Degeneracy Tolerance 0.05)
#
#        Shift (ppm)     Degeneracy  Atoms
      212.9739044122         1.0000  7
      145.5543954157         1.0000  13
      119.1881423117         1.0000  9
       86.7441840534         1.0000  4
       56.7960483999         1.0000  2
       55.1129000159         1.0000  3
       52.2125730082         1.0000  12
       46.6362969456         1.0000  16
       45.2323597884         1.0000  5
       42.0973254855         1.0000  21
       40.3796688040         1.0000  22
       39.3182010446         1.0000  1
       34.8896091685         1.0000  8
       28.5791155073         1.0000  10
       25.2318159823         1.0000  14
       23.5007316169         1.0000  18
       22.1373400406         1.0000  15
       21.8897015415         1.0000  6
       20.3172806504         1.0000  17
       19.4362881198         1.0000  19